O1-ethyl O3-(5-methoxy-1H-indol-3-yl) 2-ethyl-2-(3-methylphenyl)carbonyl-propanedioate

Systemtic Name: O1-ethyl O3-(5-methoxy-1H-indol-3-yl) 2-ethyl-2-(3-methylphenyl)carbonyl-propanedioate Openeye Name: O1-ethyl O3-(5-methoxy-1H-indol-3-yl) 2-ethyl-2-(3-methylbenzoyl)propanedioate CAS Name: 2-ethyl-2-[(3-methylphenyl)-oxomethyl]propanedioic acid O1-ethyl ester O3-(5-methoxy-1H-indol-3-yl) ester IUPAC Name: 1-O-ethyl 3-O-(5-methoxy-1H-indol-3-yl) 2-ethyl-2-(3-methylbenzoyl)propanedioate Traditional Name: 2-ethyl-2-m-toluoyl-malonic acid O1-ethyl ester O3-(5-methoxy-1H-indol-3-yl) ester Formula: C24H25NO6 MolecularWeight: 423.4584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC(=CC=C1)C)(C(=O)OCC)C(=O)OC2=CNC3=C2C=C(C=C3)OC

Isomeric SMILES

CCC(C(=O)C1=CC(=CC=C1)C)(C(=O)OCC)C(=O)OC2=CNC3=C2C=C(C=C3)OC

InChI

InChI=1S/C24H25NO6/c1-5-24(22(27)30-6-2,21(26)16-9-7-8-15(3)12-16)23(28)31-20-14-25-19-11-10-17(29-4)13-18(19)20/h7-14,25H,5-6H2,1-4H3